SCHEMBL1636749

SCHEMBL1636749

C=CCOC(OOC(OC)OCCCN1CCCC1=O)OOC(OCC=C)OOC(OC)OCCCN1CCCC1=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ PIK3CD O00329 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ POLB P06746 2/20 0.33
▸ PDK2 Q15119 1/20 0.33
▸ PGK1 P00558 1/20 0.33
▸ KDM4E B2RXH2 2/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ ADRA1B P35368 1/20 0.32
▸ NPC1 O15118 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16260479 0.83 SMN1; SMN2 (0.41) KMT2AMEN1SMN1; SMN2PIK3CDL3MBTL1
SCHEMBL1635359 0.79 PIK3CD (0.41) KMT2AMEN1SMN1; SMN2PIK3CDL3MBTL1
SCHEMBL9917278 0.72 PIK3CD (0.51) KMT2AMEN1SMN1; SMN2PIK3CDL3MBTL1
SCHEMBL4581970 0.70 L3MBTL1 (0.48) KMT2AMEN1SMN1; SMN2PIK3CDL3MBTL1
SCHEMBL7999385 0.70 KMT2A (0.47) KMT2AMEN1PIK3CDPOLBALDH1A1
SCHEMBL9921228 0.69 PIK3CD (0.47) KMT2AMEN1SMN1; SMN2PIK3CDL3MBTL1
SCHEMBL9917276 0.69 PIK3CD (0.46) KMT2AMEN1SMN1; SMN2PIK3CDL3MBTL1
SCHEMBL1634926 0.68 MEN1 (0.31) KMT2AMEN1
SCHEMBL8524128 0.67 PIK3CD (0.46) KMT2AMEN1SMN1; SMN2PIK3CDPOLB
SCHEMBL1635361 0.67 MEN1 (0.30) KMT2AMEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8835525-B2 Chain-extended polysiloxane crosslinkers with dangling hydrophilic polymer chains NOVARTIS AG (CH) 2014-09-16 — — US disclosed
US-20120088844-A1 CHAIN-EXTENDED POLYSILOXANE CROSSLINKERS WITH DANGLING HYDROPHILIC POLYMER CHAINS ALCON INC. (CH) 2012-04-12 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120088844-A1 CHAIN-EXTENDED POLYSILOXANE CROSSLINKERS WITH DANGLING HYDROPHILIC POLYMER CHAINS HACD2, HACD3, PCNA KMT2A 2976/4885MEN1 4754/4885SMN1; SMN2 2149/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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